The hydrogen bond is the most important of all directional intermolecular interactions. It is
operative in determining molecular conformation, molecular aggregation, and the function of …

Die Wasserstoffbrücke ist die wichtigste der gerichteten intermolekularen
Wechselwirkungen. Sie spielt für die molekulare Konformation, Aggregation und Funktion …

An Introduction to Hydrogen Bonding - George A. Jeffrey - Google Livres Recherche Images
Maps Play YouTube Actualités Gmail Drive Plus » Connexion Les utilisateurs de lecteurs d'écran …

MP2/aug-cc-pVTZ calculations were carried out on complexes of ZH4, ZFH3 and ZF4 (Z= C,
Si and Ge) molecules with HCN, LiCN and Cl− species acting as Lewis bases through …

Because of the importance of the hydrogen bond, there have been scores of insights gained
about its fundamental nature by quantum chemical computations over the years. Such …

Ab initio calculations are used to analyze the CH⊙⊙⊙ O interaction between F n H3-n CH
as proton donor and H2O, CH3OH, and H2CO as acceptor. The interaction is quite weak …

While the tetrahedral face of methane has an electron rich centre and can act as a hydrogen
bond acceptor, substitution of one of its hydrogens with some electron withdrawing group …

Although the peptide C α H group has historically not been thought to form hydrogen bonds
within proteins, ab initio quantum calculations show it to be a potent proton donor. Its binding …

We present calculations for the nonbonded interactions in the dimeric complexes: methane
dimer, ammonia dimer, water dimer, H2O⊙(NH3), CH4⊙(NH3), and (FHF)-as a function of …

Presented is an improved model for the prediction of phase equilibria and cage occupancy
of CH4 and CO2 hydrate in aqueous systems. Different from most hydrate models that …